Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7165274 | 1.00 | CYP3A4 (0.42) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL10024962 | 0.83 | CYP3A4 (0.46) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL16351491 | 0.83 | ESR1 (0.46) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL23581097 | 0.83 | CYP3A4 (0.46) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL12675686 | 0.83 | CYP3A4 (0.46) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL668759 | 0.80 | CYP3A4 (0.42) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL16292891 | 0.80 | CYP3A4 (0.42) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL29053288 | 0.80 | CYP3A4 (0.42) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL14954728 | 0.78 | CYP3A4 (0.41) | CYP3A4TDP1ESR1ESR2DRD1 | |
| SCHEMBL1902564 | 0.78 | MEN1 (0.43) | CYP3A4TDP1ESR1ESR2DRD1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101314608-A | Bidentate organophosphor ligand and uses thereof | EVONIK DEGUSSA AG (DE) | 2008-12-03 | — | — | CN | disclosed |
| US-6573389-B1 | As catalysts for asymmetric reaction or polymerization | DEGUSSA AG (DE) | 2003-06-03 | — | — | US | disclosed |
| EP-1175426-B1 | BIDENTATE ORGANOPHOSPHOROUS LIGANDS AND THEIR USE | DEGUSSA (DE) | 2003-05-28 | — | — | EP | disclosed |
| EP-1175426-A1 | BIDENTATE ORGANOPHOSPHOROUS LIGANDS AND THEIR USE | Degussa AG (DE) | 2002-01-30 | — | — | EP | disclosed |
| WO-2000064914-A1 | BIDENTATE ORGANOPHOSPHOROUS LIGANDS AND THEIR USE | DEGUSSA AG (DE) | 2000-11-02 | — | — | WO | disclosed |